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benzoic acid, 3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)sulfonyl]-, methyl ester

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benzoic acid, 3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)sulfonyl]-, methyl ester
SpectraBase Compound ID 9xwDTWzIO4k
InChI InChI=1S/C18H25NO4S/c1-17(2)9-14-10-18(3,11-17)12-19(14)24(21,22)15-7-5-6-13(8-15)16(20)23-4/h5-8,14H,9-12H2,1-4H3/t14-,18-/m0/s1
InChIKey SZTRMKDLPQXMSX-KSSFIOAISA-N
Mol Weight 351.46 g/mol
Molecular Formula C18H25NO4S
Exact Mass 351.150429 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DchE2rKHtcy
Name benzoic acid, 3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)sulfonyl]-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 351.150429459 u
Formula C18H25NO4S
InChI InChI=1S/C18H25NO4S/c1-17(2)9-14-10-18(3,11-17)12-19(14)24(21,22)15-7-5-6-13(8-15)16(20)23-4/h5-8,14H,9-12H2,1-4H3/t14-,18-/m0/s1
InChIKey SZTRMKDLPQXMSX-KSSFIOAISA-N
Molecular Weight 351.461 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15192
Solvent DMSO-d6
Source Vendor ID: NMR/10321611; Lab Info: LP; Lab Number: LP-2101733